Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 12Ingredient: 1Links: 12
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 64833
- Core Entity Id
- 111851
- Source Entity Count
- 1
- Preferred Name
- The Herb B
- Name En
- Pubchem Id
- 23664719
- Smiles Canonical
- C[As](=O)(O)[O-].[Na+]
- Molecular Formula
- C38H48O19
- Molecular Weight
- 161.9520
- Inchikey
- JITOKQVGRJSHHA-UHFFFAOYSA-M
- Inchi
- InChI=1S/CH5AsO3.Na/c1-2(3,4)5;/h1H3,(H2,3,4,5);/q;+1/p-1
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- -4.6578
- Num H Donors
- 1
- Num H Acceptors
- 3
- Num Rotatable Bonds
- 0
- Drug Likeness
- Polar Surface Area
- 60.4000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
The Herb B
Role
preferred
Source
SymMap_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Sym Map
SMIT27120
Pub Chem
23664719
Itcmdb Generated
ITX-INGREDIENT-16C684F9AB88
Attributes
Merged source attributes and domain-specific metadata.
Type
QC ingredients
Version
v2
Suppress
0
Molecule Formula
C38H48O19